7-(1,3-benzothiazol-2-yl)-2-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-(1,3-benzothiazol-2-yl)-2-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
7-(1,3-benzothiazol-2-yl)-2-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D472-1006 |
| Compound Name: | 7-(1,3-benzothiazol-2-yl)-2-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 483.57 |
| Molecular Formula: | C24 H17 N7 O S2 |
| Smiles: | Cc1c2c(ncn3c2nc(CSc2nc4ccccc4o2)n3)n(c1C)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 5.6097 |
| logD: | 5.557 |
| logSw: | -5.911 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.007 |
| InChI Key: | COUBSKNFCNVNOE-UHFFFAOYSA-N |